SCHEMBL7394697

SCHEMBL7394697

O=C(Nc1ccc(S(=O)(=O)CC(O)(CSc2ccc(O)cc2)C(=O)O)cc1)c1ccc(Cl)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT1 Q99873 2/20 0.45
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA9 Q16790 1/20 0.45
KMT2A Q03164 5/20 0.45
POLB P06746 2/20 0.45
PPARG P37231 1/20 0.45
NCOA2 Q15596 1/20 0.45
NCOA1 Q15788 1/20 0.45
NCOA3 Q9Y6Q9 1/20 0.45
MAPT P10636 2/20 0.44
HSD17B10 Q99714 1/20 0.44
MEN1 O00255 4/20 0.43
USP2 O75604 1/20 0.43
NPC1 O15118 2/20 0.42
ENPP1 P22413 5/20 0.41
ENPP3 O14638 4/20 0.41
AURKA O14965 1/20 0.41
ENPP2 Q13822 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7394619 0.92 PRMT1 (0.52) PRMT1CA12CA1CA9KMT2A
SCHEMBL7398968 0.92 PRMT1 (0.52) PRMT1CA12CA1CA9KMT2A
SCHEMBL7388689 0.91 ENPP1 (0.51) PRMT1CA12CA1CA9KMT2A
SCHEMBL7396188 0.90 NPC1 (0.46) KMT2APOLBPPARGNCOA2NCOA1
SCHEMBL7395377 0.83 PRMT1 (0.48) PRMT1CA12CA1CA9KMT2A
SCHEMBL7394539 0.82 KMT2A (0.50) KMT2APOLBPPARGNCOA2NCOA1
SCHEMBL7396365 0.81 NPC1 (0.51) KMT2APOLBPPARGNCOA2NCOA1
SCHEMBL7483398 0.81 SMN1; SMN2 (0.50) PRMT1KMT2AMAPTMEN1USP2
SCHEMBL7433039 0.81 MEN1 (0.42) PRMT1CA12CA1CA9KMT2A
SCHEMBL7395666 0.80 NAMPT (0.49) PRMT1CA12CA1CA9KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002006215-A1 3-ARYLSULFONYL-2-HYDROXY-2-METHYLPROPANOIC ACID DERIVATES PHARMACIA ITALIA S.P.A. (IT) 2002-01-24 WO claimed
WO-2002006215-A1 3-ARYLSULFONYL-2-HYDROXY-2-METHYLPROPANOIC ACID DERIVATES PHARMACIA ITALIA S.P.A. (IT) 2002-01-24 WO disclosed